Name: Name:2-[(3-chlorophenyl)(cyanomethyl)amino]acetic acid
Brand: Angene
SKU: AG01AHZQ
Rating: 90 (10 reviews)

2-[(3-chlorophenyl)(cyanomethyl)amino]acetic acid

CAS No.:

1179673-92-7

Catalog Number:

AG01AHZQ

Molecular Formula:

C10H9ClN2O2

Molecular Weight:

224.6437

Catalog Number:

AG01AHZQ

Chemical Name:

2-[(3-chlorophenyl)(cyanomethyl)amino]acetic acid

CAS Number:

1179673-92-7

Molecular Formula:

C10H9ClN2O2

Molecular Weight:

224.6437

MDL Number:

MFCD12159254

IUPAC Name:

2-[3-chloro-N-(cyanomethyl)anilino]acetic acid

InChI:

InChI=1S/C10H9ClN2O2/c11-8-2-1-3-9(6-8)13(5-4-12)7-10(14)15/h1-3,6H,5,7H2,(H,14,15)

InChI Key:

GMWKRMYQFTWUIT-UHFFFAOYSA-N

SMILES:

N#CCN(c1cccc(c1)Cl)CC(=O)O

Complexity:

274

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

224.035g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

224.644g/mol

Monoisotopic Mass:

224.035g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

64.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.1